N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]-2-phenoxy-ethanamide Openeye Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-isopropyl-benzimidazol-5-yl]-2-phenoxy-acetamide CAS Name: N-[2-[(4-ethyl-1-piperazin-4-iumyl)methyl]-1-propan-2-yl-5-benzimidazolyl]-2-phenoxyacetamide IUPAC Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-ylbenzimidazol-5-yl]-2-phenoxyacetamide Traditional Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-isopropyl-benzimidazol-5-yl]-2-phenoxy-acetamide Formula: C25H34N5O2+ MolecularWeight: 436.56976

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C25H33N5O2/c1-4-28-12-14-29(15-13-28)17-24-27-22-16-20(10-11-23(22)30(24)19(2)3)26-25(31)18-32-21-8-6-5-7-9-21/h5-11,16,19H,4,12-15,17-18H2,1-3H3,(H,26,31)/p+1